ChemSpider 2D Image | [1-(4-Nitroso-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazol-4-yl]methanol | C5H4N6O3

[1-(4-Nitroso-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazol-4-yl]methanol

  • Molecular FormulaC5H4N6O3
  • Average mass196.124 Da
  • Monoisotopic mass196.034485 Da
  • ChemSpider ID61001545

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[1-(4-Nitroso-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazol-4-yl]methanol [German] [ACD/IUPAC Name]
[1-(4-Nitroso-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazol-4-yl]methanol [ACD/IUPAC Name]
[1-(4-Nitroso-1,2,5-oxadiazol-3-yl)-1H-1,2,3-triazol-4-yl]méthanol [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-methanol, 1-(4-nitroso-1,2,5-oxadiazol-3-yl)- [ACD/Index Name]
1823358-26-4 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 2.1±0.1 g/cm3
Boiling Point: 483.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.9±3.0 kJ/mol
Flash Point: 246.4±26.5 °C
Index of Refraction: 1.907
Molar Refractivity: 42.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.06
ACD/LogD (pH 5.5): -1.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.60
ACD/LogD (pH 7.4): -1.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.60
Polar Surface Area: 119 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 117.5±7.0 dyne/cm
Molar Volume: 91.5±7.0 cm3

Click to predict properties on the Chemicalize site


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